Base information
| Cat. No. | |
| CAS No. | 80945-66-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9N3S |
| Molecular Weight | 179.242 |
| Exact Mass | 179.052 |
| XLogP3 | 2.6636 |
| Mr | 51.7921 |
| PSA | 79.18 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | NNc1nc2c(s1)ccc(c2)C |
